Primitives | Contractions... | |||
---|---|---|---|---|
9.208290 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
5.583680 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
2.741630 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
1.370810 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pwCVTZ-PP/MP2Fit: C. Hattig and A. Hellweg, Unpublished results from Turbomole.